2-[2-(1H-1,2,4-triazol-3-ylsulfanyl)acetamido]benzamide

2-[2-(1H-1,2,4-triazol-3-ylsulfanyl)acetamido]benzamide

Formula: C11H11N5O2S

SMILES: NC(=O)C1=CC=CC=C1NC(=O)CSC1=NNC=N1

IUPAC: 2-[2-(1H-1,2,4-triazol-3-ylsulfanyl)acetamido]benzamide

InChI: InChI=1S/C11H11N5O2S/c12-10(18)7-3-1-2-4-8(7)15-9(17)5-19-11-13-6-14-16-11/h1-4,6H,5H2,(H2,12,18)(H,15,17)(H,13,14,16)

Composition: C (47.65%), H (4.00%), N (25.26%), O (11.54%), S (11.56%)

Molar Mass: 277.3

Atom Count: 30

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	277.063345788
Formal Charge	0
FSP3	0.09
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
InChIKey	JAOOUIFYVAPKER-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	75.21
Topological Polar Surface Area	113.76
Polarizability	26.72
Ring Count	2
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C11H11N5O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00